4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=47.262630874123275 stress="-6.254368381674327 0.10264746098276036 0.010647637122316641 0.10264746098276036 -4.914451953633614 -0.04372797276156103 0.010647637122316641 -0.04372797276156103 -7.242815790627297" pbc="T F T" W 0.03848316 0.19178619 0.17895518 23.91969788 -48.98638137 -17.57421100 W 1.79140871 1.61455359 0.03253581 -27.83078067 50.14853620 -7.85257293 W 1.64904689 0.10609294 1.46603997 -26.66145364 -51.54616613 13.47108955 W -0.19401975 1.32157598 1.51361598 30.57253643 50.38401130 11.95569437